BDBM25768 1-[(7-methyl-2,3-dihydro-1H-inden-4-yl)oxy]-3-(propan-2-ylamino)butan-2-ol::ICI 118,551::ICI 118551

SMILES: Cc1ccc(c2c1CCC2)OC[C@H]([C@H](C)NC(C)C)O

InChI Key: InChIKey=VFIDUCMKNJIJTO-UHFFFAOYSA-N

Data: 9 KI  4 IC50  6 Kd

PDB links: 2 PDB IDs match this monomer.

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 19 hits for monomerid = 25768   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Beta-2 adrenergic receptor (Human)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	0.550	n/a	n/a	n/a	n/a	n/a
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Sodium channel protein type 1/2/3 subunit alpha (Human)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Beta-2 adrenergic receptor (Human)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.740	n/a	n/a	n/a	n/a	n/a	n/a
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Beta-1 adrenergic receptor (Human)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	240	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Beta-2 adrenergic receptor (Human)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	0.676	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Beta-2 adrenergic receptor (Human)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Beta-2 adrenergic receptor (Human)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	6.30	n/a	n/a	n/a	n/a	n/a
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Beta-2 adrenergic receptor (Rat)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.30	n/a	n/a	n/a	n/a	n/a	n/a
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Beta-3 adrenergic receptor (Human)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	363	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Beta-1 adrenergic receptor (Human)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	302	n/a	n/a	n/a	7.4	37
TBA									Citation and Details
					More data for this Ligand-Target Pair
Beta-2 adrenergic receptor (Human)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		0.570	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Beta-2 adrenergic receptor (Human)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		0.630	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Beta-2 adrenergic receptor (Human)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		0.700	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Beta-2 adrenergic receptor (Rat)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		1.78	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Beta-1 adrenergic receptor (Human)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		49.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Beta-1 adrenergic receptor (Human)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		135	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Beta-1 adrenergic receptor (Rat)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		195	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Beta-3 adrenergic receptor (Human)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		611	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 1B (Rat)	BDBM25768 (ICI 118,551 | 1-[(7-methyl-2,3-dihydro-1H-inden-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		3.89E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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